3-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)C2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)C2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C16H18N4O2S/c1-3-8-20-15(22)18-19-16(20)23-9-13(21)14-10(2)17-12-7-5-4-6-11(12)14/h4-7,17H,3,8-9H2,1-2H3,(H,18,22)